SCHEMBL6310349

SCHEMBL6310349

CC(C)(C)OC(=O)N1CC(C(=O)O)C(c2ccc(Cl)cc2Cl)C1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.53
PDE4B Q07343 4/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CNR1 P21554 1/20 0.48
MC4R P32245 1/20 0.42
RORC P51449 1/20 0.42
TACR1 P25103 2/20 0.41
USP30 Q70CQ3 1/20 0.41
STS P08842 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6310363 0.89 PDE4B (0.59) DPP4PDE4BMEN1KMT2ACNR1
SCHEMBL16780715 0.86 PDE4B (0.48) PDE4BMEN1KMT2ACNR1RORC
SCHEMBL31450144 0.86 PDE4B (0.48) PDE4BMEN1KMT2ACNR1RORC
SCHEMBL16780718 0.86 PDE4B (0.48) PDE4BMEN1KMT2ACNR1RORC
SCHEMBL16780714 0.86 PDE4B (0.48) PDE4BMEN1KMT2ACNR1RORC
SCHEMBL23216432 0.85 PDE4B (0.48) DPP4PDE4BCNR1MC4RRORC
SCHEMBL24946334 0.85 PDE4B (0.48) DPP4PDE4BCNR1MC4RRORC
SCHEMBL29768413 0.85 PDE4B (0.48) DPP4PDE4BCNR1MC4RRORC
SCHEMBL13858719 0.84 PDE4B (0.57) PDE4BMC4RRORCTACR1STS
SCHEMBL16780015 0.84 PDE4B (0.57) PDE4BMC4RRORCTACR1STS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050192286-A1 Ligands of melanocortin receptors and compositions and methods related thereto NEUROCRINE BIOSCIENCES, INC. (US) 2005-09-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050192286-A1 Ligands of melanocortin receptors and compositions and methods related thereto MC3R, MC1R, MC5R DPP4 3446/4885PDE4B 892/4885MEN1 155/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.